benzenesulfonate; tributylazanium

Systemtic Name: benzenesulfonate; tributylazanium Openeye Name: benzenesulfonate; tributylammonium CAS Name: benzenesulfonate; tributylammonium IUPAC Name: benzenesulfonate; tributylazanium Traditional Name: tributylammonium besylate Formula: C18H33NO3S MolecularWeight: 343.52452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCCC.C1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCC[NH+](CCCC)CCCC.C1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C12H27N.C6H6O3S/c1-4-7-10-13(11-8-5-2)12-9-6-3;7-10(8,9)6-4-2-1-3-5-6/h4-12H2,1-3H3;1-5H,(H,7,8,9)